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Home > Other Heterocycles > 827037-94-5
827037-94-5 | Spiro[cyclohexane-1,2'(3'H)-[1H]perimidine], 1',3'-diethyl-
CAS No: 827037-94-5 Catalog No: AG0050V6 MDL No:
Product Description
Catalog Number:
AG0050V6
Chemical Name:
Spiro[cyclohexane-1,2'(3'H)-[1H]perimidine], 1',3'-diethyl-
CAS Number:
827037-94-5
Molecular Formula:
C20H26N2
Molecular Weight:
294.4338
IUPAC Name:
1',3'-diethylspiro[cyclohexane-1,2'-perimidine]
InChI:
InChI=1S/C20H26N2/c1-3-21-17-12-8-10-16-11-9-13-18(19(16)17)22(4-2)20(21)14-6-5-7-15-20/h8-13H,3-7,14-15H2,1-2H3
InChI Key:
HNAIDMLLUBPFPB-UHFFFAOYSA-N
SMILES:
CCN1c2cccc3c2c(N(C21CCCCC2)CC)ccc3
Properties
Complexity:
359
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
294.21g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
294.442g/mol
Monoisotopic Mass:
294.21g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
6.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.7
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